CID 23356

1-azidohexane

Structural Information

Molecular Formula
C6H13N3
SMILES
CCCCCCN=[N+]=[N-]
InChI
InChI=1S/C6H13N3/c1-2-3-4-5-6-8-9-7/h2-6H2,1H3
InChIKey
KFQRCGONYHVDKX-UHFFFAOYSA-N
Compound name
1-azidohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

238
Patents

127.11095 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.11823 126.8
[M+Na]+ 150.10017 133.0
[M-H]- 126.10367 129.8
[M+NH4]+ 145.14477 149.3
[M+K]+ 166.07411 128.9
[M+H-H2O]+ 110.10821 125.8
[M+HCOO]- 172.10915 157.5
[M+CH3COO]- 186.12480 177.6
[M+Na-2H]- 148.08562 137.0
[M]+ 127.11040 126.3
[M]- 127.11150 126.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe